English

Hybrid Monte Carlo simulation of polymer chains

High Energy Physics - Lattice 2009-10-22 v1

Abstract

We develop the hybrid Monte Carlo method for simulations of single off-lattice polymer chains. We discuss implementation and choice of simulation parameters in some detail. The performance of the algorithm is tested on models for homopolymers with short- or long-range self-repulsion, using chains with 16N51216\le N\le 512 monomers. Without excessive fine tuning, we find that the computational cost grows as N2+zN^{2+z^\prime} with 0.64<z<0.840.64<z^\prime<0.84. In addition, we report results for the scaling of the end-to-end distance, r1NNν(lnN)αr_{1N}\sim N^\nu(\ln N)^{-\alpha}.

Keywords

Cite

@article{arxiv.hep-lat/9312029,
  title  = {Hybrid Monte Carlo simulation of polymer chains},
  author = {A. Irbäck},
  journal= {arXiv preprint arXiv:hep-lat/9312029},
  year   = {2009}
}

Comments

13 pages, single postscript file, uuencoded form, Lund Preprint LU-TP 93-20